⚠ Novel chemotype — no close known analogue (best Tanimoto < 0.3). Unexplored chemical space relative to ChEMBL.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| Bitoscanate SCHEMBL157128 | 0.80 | MIF (0.72) | — | |
| SCHEMBL5646332 | 0.77 | — | — | |
| Phenylisothiocyanate SCHEMBL27304859 | 0.76 | MIF (0.94) | — | |
| SCHEMBL1479272 | 0.74 | — | — | |
| SCHEMBL1548531 | 0.72 | MIF (0.62) | — | |
| Phenylisothiocyanate SCHEMBL20984 | 0.72 | — | — | |
| Phenylisothiocyanate SCHEMBL25197976 | 0.70 | MIF (0.94) | — | |
| Phenylisothiocyanate SCHEMBL8978101 | 0.70 | MIF (0.94) | — | |
| Phenylisothiocyanate SCHEMBL29001974 | 0.70 | MIF (0.94) | — | |
| Phenylisothiocyanate SCHEMBL29672744 | 0.70 | MIF (0.94) | — |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 257 patents — showing the first 20. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-115448861-A | Ethyl naphthalene series liquid crystal monomer compound, and preparation method and application thereof | 中节能万润股份有限公司 | 2022-12-09 | — | — | CN | claimed |
| CN-115093418-A | [1,2,3] triazolo [4,5-d ] pyrimidine derivatives having affinity for cannabinoid type 2 receptors | 豪夫迈·罗氏有限公司 | 2022-09-23 | — | — | CN | claimed |
| CN-115073476-A | [1,2,3] triazolo [4,5-d ] pyrimidine derivatives having affinity for cannabinoid type 2 receptors | 豪夫迈·罗氏有限公司 | 2022-09-20 | — | — | CN | claimed |
| CN-114032212-A | DC cell preparation method for improving antigen presenting T cells and improving T cell killing efficiency and application thereof | 北京荟科柘生物科技有限公司 | 2022-02-11 | — | — | CN | claimed |
| CN-106558534-B | Structure and method for interconnection | 台湾积体电路制造股份有限公司 | 2020-07-31 | — | — | CN | claimed |
| US-10457685-B2 | [1,2,3]triazolo[4,5-D]pyrimidine derivatives with affinity for the type-2 cannabinoid receptor | HOFFMANN-LA ROCHE INC. (US) | 2019-10-29 | — | — | US | claimed |
| CN-106653681-B | Autoregistration interconnection structure and method | 台湾积体电路制造股份有限公司 | 2019-08-02 | — | — | CN | claimed |
| US-20190127384-A1 | [1,2,3]TRIAZOLO[4,5-D]PYRIMIDINE DERIVATIVES WITH AFFINITY FOR THE TYPE-2 CANNABINOID RECEPTOR | HOFFMANN-LA ROCHE INC. (US) | 2019-05-02 | — | — | US | claimed |
| EP-3475282-A1 | [1,2,3]TRIAZOLO[4,5-D]PYRIMIDINE DERIVATIVES WITH AFFINITY FOR THE TYPE-2 CANNABINOID RECEPTOR | H. Hoffnabb-La Roche Ag (CH) | 2019-05-01 | — | — | EP | claimed |
| CN-109385267-A | A kind of rare earth-phosphonic acids ultra-thin two-dimension material and its preparation method and application | 复旦大学 | 2019-02-26 | — | — | CN | claimed |
| EP-0529175-A1 | Conjugates chelated with paramagnetic metals for targetting | BRACCO International B.V. (NL) | 1993-03-03 | — | — | EP | claimed |
| WO-1993001837-A1 | CONJUGATED MOIETIES FOR CHELATING PARAMAGNETIC METALS | SINTETICA S.A. (CH) | 1993-02-04 | — | — | WO | claimed |
| US-5030383-A | With low temperature dependence of threshold voltage | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1991-07-09 | — | — | US | claimed |
| EP-0258349-B1 | ELECTRO-OPTICAL DISPLAY ELEMENT | MERCK PATENT GmbH (DE) | 1990-05-23 | — | — | EP | claimed |
| US-4808541-A | Determination method utilizing reagents covalently labelled with essentially non-fluorescent lanthanide chelates in combination with time-resolved fluorescence spectroscopy and the reagents to be used in the method | LKB PRODUKTER AB (SE) | 1989-02-28 | — | — | US | claimed |
| EP-0258349-A1 | ELECTRO-OPTICAL DISPLAY ELEMENT. | MERCK PATENT GMBH (DE) | 1988-03-09 | — | — | EP | claimed |
| WO-1987005318-A1 | ELECTRO-OPTICAL DISPLAY ELEMENT | MERCK Patent Gesellschaft mit beschränkter Haftung (DE) | 1987-09-11 | — | — | WO | claimed |
| EP-0139675-B1 | COMPOUND | LKB-Produkter AB (SE) | 1987-01-28 | — | — | EP | claimed |
| EP-0139675-A1 | COMPOUND. | LKB PRODUKTER AB (SE) | 1985-05-08 | — | — | EP | claimed |
| WO-1984003698-A1 | COMPOUND | LKB PRODUKTER AB (SE) | 1984-09-27 | — | — | WO | claimed |